N-[2-(5-methyl-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine

C17H26N2 — CID 23815452

IUPACN-[2-(5-methyl-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine
SMILESCc1ccc2[nH]cc(CCN(C(C)C)C(C)C)c2c1
InChIInChI=1S/C17H26N2/c1-12(2)19(13(3)4)9-8-15-11-18-17-7-6-14(5)10-16(15)17/h6-7,10-13,18H,8-9H2,1-5H3
InChIKeyFALDPYRKHVJUBA-UHFFFAOYSA-N
MW258.41 g/mol
LogP4.14
Rot. Bonds5

About N-[2-(5-methyl-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine

N-[2-(5-methyl-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine (PubChem CID 23815452) has the molecular formula C17H26N2 and a molecular weight of 258.41 g/mol. Its IUPAC name is N-[2-(5-methyl-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine.

Molecular Properties

Compound NameN-[2-(5-methyl-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine
PubChem CID23815452
Molecular FormulaC17H26N2
Molecular Weight258.41 g/mol
Exact Mass258.21
IUPAC NameN-[2-(5-methyl-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine
SMILESCc1ccc2[nH]cc(CCN(C(C)C)C(C)C)c2c1
InChIInChI=1S/C17H26N2/c1-12(2)19(13(3)4)9-8-15-11-18-17-7-6-14(5)10-16(15)17/h6-7,10-13,18H,8-9H2,1-5H3
InChIKeyFALDPYRKHVJUBA-UHFFFAOYSA-N
XLogP4.14
TPSA19.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine;hydrochloride
CID 24802109
N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine;hydrate;hydrochloride
CID 71311787
3-(3-methoxypropyl)-5-methyl-1H-indole
CID 66596207
2-(5-methyl-1H-indol-3-yl)ethyl methanesulfonate
CID 86602334
butanedioic acid;bis(N-[2-(1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine)
CID 175918021
2-(5-methyl-1H-indol-3-yl)ethyl formate
CID 174764369
3-[2-(dimethylamino)ethyl]-1H-indol-5-ol;hydrobromide
CID 171764243
2-amino-3-(5-methyl-1H-indol-3-yl)propan-1-ol
CID 66932814
[3-[2-[methyl(propan-2-yl)amino]ethyl]-1H-indol-5-yl] propanoate
CID 169222529
3-[2-(2,6-dimethylpiperidin-1-yl)ethyl]-5-methyl-1H-indole
CID 19848863
2-chloro-N-[2-(5-methyl-1H-indol-3-yl)ethyl]acetamide
CID 17339304
N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-N-methylbutan-2-amine
CID 166158013

Frequently Asked Questions

What is the IUPAC name of N-[2-(5-methyl-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine?
The IUPAC name of N-[2-(5-methyl-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine (CID 23815452) is N-[2-(5-methyl-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine.
What is the SMILES notation for N-[2-(5-methyl-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine?
The canonical SMILES for N-[2-(5-methyl-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine is Cc1ccc2[nH]cc(CCN(C(C)C)C(C)C)c2c1.
What is the InChIKey of N-[2-(5-methyl-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine?
The InChIKey is FALDPYRKHVJUBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2/c1-12(2)19(13(3)4)9-8-15-11-18-17-7-6-14(5)10-16(15)17/h6-7,10-13,18H,8-9H2,1-5H3.
What are the key properties of N-[2-(5-methyl-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine?
N-[2-(5-methyl-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine has a molecular weight of 258.41 g/mol, XLogP of 4.14, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-methyl-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine is sourced from PubChem (CID 23815452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).